| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 6th, 2008 | 39 | No |
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 4.29 | 10.83 | -15.92 | 1 | 7 | 0 | 89 | 524.548 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.70 | 11.51 | -24.11 | 0 | 7 | 0 | 86 | 524.548 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 4.73 | 10.79 | -59.75 | 2 | 7 | 1 | 90 | 525.556 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 3.70 | 11.79 | -54.52 | 1 | 7 | 1 | 87 | 525.556 | 9 | ↓ |
